5VPM

Crystal Structure of Human Renin in Complex with a biphenylpipderidinylcarbinol

Summary for 5VPM

Entry DOI	10.2210/pdb5vpm/pdb
Descriptor	Renin, 2-acetamido-2-deoxy-beta-D-glucopyranose, methyl [(4S)-4-(3'-ethyl-6-fluoro[1,1'-biphenyl]-2-yl)-4-hydroxy-4-{(3R)-1-[(piperidin-4-yl)acetyl]piperidin-3-yl}butyl]carbamate, ... (5 entities in total)
Functional Keywords	renin inhibitor, biphenyl, hypertension, cyp 3a4, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Homo sapiens (Human)
Cellular location	Secreted: P00797
Total number of polymer chains	2
Total formula weight	75621.15
Authors	Concha, N.,Zhao, B. (deposition date: 2017-05-05, release date: 2017-10-18, Last modification date: 2020-07-29)
Primary citation	Lawhorn, B.G.,Tran, T.,Hong, V.S.,Morgan, L.A.,Le, B.T.,Harpel, M.R.,Jolivette, L.,Diaz, E.,Schwartz, B.,Gross, J.W.,Tomaszek, T.,Semus, S.,Concha, N.,Smallwood, A.,Holt, D.A.,Kallander, L.S. Discovery of renin inhibitors containing a simple aspartate binding moiety that imparts reduced P450 inhibition. Bioorg. Med. Chem. Lett., 27:4838-4843, 2017 Cited by PubMed: 28985999 DOI: 10.1016/j.bmcl.2017.09.046 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.9 Å)

Structure validation